%chk=000206549.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206549

0 1
O 6.858002 0.471450 -0.491538
O -6.649823 2.292846 0.283604
N -0.066928 -1.784008 -0.815843
C 1.948135 -0.406791 -0.389498
C 1.953632 -0.837612 -1.887689
C 0.916987 -1.393257 0.243359
C 0.718232 -1.739865 -2.096036
C 1.449195 1.054284 -0.258343
C 3.340189 -0.502995 0.218433
C -1.257849 -0.873987 -0.862003
C 1.396370 1.554632 1.190842
C 4.427738 0.049783 -0.484641
C -2.186096 -1.188535 0.325982
C 3.558203 -1.089796 1.470629
C 0.784635 2.950328 1.281579
C 5.703817 -0.019950 0.079688
C 4.849750 -1.148977 2.016116
C -3.396428 -0.299494 0.296884
C 5.938454 -0.621043 1.334339
C -4.588720 -0.738871 -0.289556
C -3.334434 0.992769 0.855487
C -5.720276 0.084421 -0.325716
C -4.442228 1.830339 0.832638
C -5.632473 1.361318 0.237435
C 6.757016 1.118757 -1.781878
C -7.928005 1.923864 -0.285329
H 2.874820 -1.395285 -2.131607
H 1.933363 0.032364 -2.560883
H 0.419087 -0.964836 1.133006
H 1.417169 -2.332667 0.565749
H 0.105524 -1.409547 -2.953548
H 1.027740 -2.786188 -2.308261
H 0.434739 1.125228 -0.712185
H 2.098026 1.722819 -0.854807
H -1.805230 -1.059490 -1.811379
H -0.977808 0.207066 -0.856013
H 2.417769 1.562995 1.623456
H 0.812456 0.847437 1.814037
H 4.266427 0.526776 -1.444303
H -1.639223 -1.070275 1.283850
H -2.472294 -2.260713 0.295625
H 2.732526 -1.506664 2.040932
H 1.362531 3.682654 0.706175
H -0.242259 2.970632 0.899689
H 0.756068 3.301753 2.319410
H 4.998300 -1.615885 2.990481
H 6.946824 -0.656449 1.735816
H -4.643884 -1.736075 -0.726316
H -2.406422 1.338886 1.311131
H -6.635135 -0.275209 -0.782521
H -4.415564 2.829437 1.260236
H 6.121288 2.005977 -1.713381
H 6.394390 0.412697 -2.534094
H 7.801192 1.397414 -1.975396
H -7.825617 1.728784 -1.356493
H -8.523368 2.828521 -0.105675
H -8.348629 1.066431 0.247624


%chk=000206549-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000206549

0 1
O 6.835225 -1.489193 -0.440800
O -7.840506 0.637811 0.610293
N -0.127412 -0.251199 -1.010510
C 2.162734 0.429541 -0.425784
C 2.017308 0.012863 -1.933877
C 0.740140 0.089078 0.154505
C 0.529270 0.247178 -2.240015
C 2.425264 1.981247 -0.369806
C 3.321180 -0.295759 0.279758
C -1.551941 0.083230 -0.863789
C 2.543525 2.616386 1.033589
C 4.516319 -0.567614 -0.440866
C -2.258758 -0.791575 0.207463
C 3.269181 -0.639990 1.653345
C 2.772705 4.142323 0.958899
C 5.620085 -1.180048 0.197721
C 4.376887 -1.255336 2.284899
C -3.738777 -0.464146 0.322749
C 5.555366 -1.531183 1.568546
C -4.714149 -1.215709 -0.374337
C -4.185330 0.639956 1.100040
C -6.090142 -0.892099 -0.311861
C -5.548005 0.980324 1.177416
C -6.506675 0.214551 0.467536
C 6.963525 -1.146601 -1.857423
C -8.866896 -0.119350 -0.107109
H 2.251196 -1.060279 -2.052249
H 2.679815 0.597173 -2.598112
H 0.331863 0.964636 0.714197
H 0.774885 -0.764506 0.855558
H 0.329607 1.331946 -2.434518
H 0.180091 -0.319247 -3.123193
H 1.610462 2.490411 -0.925299
H 3.364568 2.186446 -0.924405
H -2.049813 -0.081986 -1.838586
H -1.702723 1.164450 -0.601844
H 3.376094 2.141965 1.585812
H 1.624104 2.416107 1.620371
H 4.571995 -0.304813 -1.501397
H -1.757707 -0.637812 1.182895
H -2.108350 -1.851394 -0.069533
H 2.370710 -0.426629 2.241138
H 3.701618 4.378001 0.405644
H 1.936425 4.648660 0.440145
H 2.861554 4.584731 1.968123
H 4.318744 -1.519119 3.346914
H 6.421950 -2.007665 2.036399
H -4.397346 -2.076291 -0.976919
H -3.453216 1.235657 1.659523
H -6.813409 -1.502460 -0.861232
H -5.894907 1.826557 1.778604
H 6.860967 -0.055579 -2.020906
H 6.215911 -1.683900 -2.473710
H 7.976339 -1.468954 -2.141018
H -8.701745 -0.086681 -1.202138
H -9.816585 0.378334 0.138863
H -8.901323 -1.174249 0.229592


